AG00359C

59237-53-5 | Methyl6-Chloro-5-Nitronicotinate

AG00359C

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CAS Number	59237-53-5
Catalog Number	AG00359C(AGN-PC-0JMHWE)
Chemical Name	Methyl6-Chloro-5-Nitronicotinate
IUPAC Name	methyl 6-chloro-5-nitropyridine-3-carboxylate
InChI	InChI=1S/C7H5ClN2O4/c1-14-7(11)4-2-5(10(12)13)6(8)9-3-4/h2-3H,1H3
InChI Key	BRPREIDVQXJOJH-UHFFFAOYSA-N
MDL Number	MFCD01928341
Molecular Formula	C7H5ClN2O4
Molecular Weight	216.5786
NSC Number	405361
SMILES	COC(C1=CN=C(C(=C1)[N+](=O)[O-])Cl)=O
Synonyms	Methyl 6-chloro-5-nitronicotinate, 59237-53-5, methyl 6-chloro-5-nitropyridine-3-carboxylate, METHYL6-CHLORO-5-NITRONICOTINATE, 6-Chloro-5-nitropyridine-3-carboxylic acid methyl ester, methyl 6-chloro-5-nitro-nicotinate, 6-CHLORO-5-NITRONICOTINIC ACID METHYL ESTER, 6-Chloro-5-nitro-nicotinic acid methyl ester, methyl 6-chloro-5-nitro-pyridine-3-carboxylate, 3-PYRIDINECARBOXYLIC ACID, 6-CHLORO-5-NITRO-, METHYL ESTER, MFCD01928341, NSC405361, PubChem17668, ACMC-209mbl, SCHEMBL70813, CHEMBL1973028, CTK5A9642, KS-00000BVE, DTXSID40323982, BRPREIDVQXJOJH-UHFFFAOYSA-N, ZINC987859, methyl 6-chloro-5-nitronicotinoate, AC1L8664, ACT02457, CS-B0656, AN-225, ANW-33199, CL0241, SBB095315, AKOS005264545, AB10536, GS-3917, HP12000, NSC-405361, QC-8258, RP05015, TRA0093676, AC-23254, AJ-24646, AK-48993, BP-11553, BR-48993, NCI60_003831, SC-35681, SY031498, 6-Chloro-5-nitronicotinicacid methyl ester, 6-CHLORO-5-NITRO METHYL NICOTINATE, AB0006946, DB-013407, TR-037199, 4CH-009114, FT-0688474, ST24031165, W7217, 2-Chloro-5-(methoxycarbonyl)-3-nitropyridine, MFCD01928341 (95%), A-3580, 237C535, J-522547, METHYL 2-CHLORO-3-NITROPYRIDINE-5-CARBOXYLATE, 5-Nitro-6-chloropyridine-3-carboxylic acid methyl ester, 3-Pyridinecarboxylicacid, 6-chloro-5-nitro-, methyl ester, 6-CHLORO-5-NITROPYRIDINE-3-CARBOXYLIC ACID METHYLESTER, C7H5ClN2O4, METHYL-6-CHLORO-5-NITRONICOTINATE, CID346961, ACN-036521, 6-CHLORO-5-NITRO-3-PYRIDINECARBOXYLIC ACID, methyl 6-chloro-5-nitropyridine-3-carboxylate, 95% - 1G 1g,

Complexity	242
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.994g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	216.577g/mol
Monoisotopic Mass	215.994g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	85A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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